N-[1-[(3-chlorophenyl)methyl]-1,2,4-triazol-3-yl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[1-[(3-chlorophenyl)methyl]-1,2,4-triazol-3-yl]-4-nitro-benzenesulfonamide Openeye Name: N-[1-[(3-chlorophenyl)methyl]-1,2,4-triazol-3-yl]-4-nitro-benzenesulfonamide CAS Name: N-[1-[(3-chlorophenyl)methyl]-1,2,4-triazol-3-yl]-4-nitrobenzenesulfonamide IUPAC Name: N-[1-[(3-chlorophenyl)methyl]-1,2,4-triazol-3-yl]-4-nitrobenzenesulfonamide Traditional Name: N-[1-(3-chlorobenzyl)-1,2,4-triazol-3-yl]-4-nitro-benzenesulfonamide Formula: C15H12ClN5O4S MolecularWeight: 393.80488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)CN2C=NC(=N2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)CN2C=NC(=N2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H12ClN5O4S/c16-12-3-1-2-11(8-12)9-20-10-17-15(18-20)19-26(24,25)14-6-4-13(5-7-14)21(22)23/h1-8,10H,9H2,(H,18,19)